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More_Info:
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['1 . Appearance Colourless Liquid 。 ', '2 相对. Density（g/mL,20/4℃）08250 ', '3 相对. Density（25℃，4℃）08214 ', '4 . Melting point（ºC）22 ', '5 . Boiling point（ºC,Atmospheric pressure）1947 ', '6 常温. Refractive index（n25）1429 ', '7 . Refractive index（n20ºC）1431 ', '8 . Flash point（ºC）96 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）37485 ', '15 临界. Density（g·cm-3）0250 ', '16 临界体积（cm3·mol-1）577 ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility 能Soluble in Ethanol Ethyl ether 混溶，Insoluble in Water 。']
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Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :617 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
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